[2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-propan-2-yloxypropylamino)ethyl] 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate Openeye Name: [2-(3-isopropoxypropylamino)-2-oxo-ethyl] 2-methylsulfanyl-3-phenyl-imidazole-4-carboxylate CAS Name: 2-(methylthio)-3-phenyl-4-imidazolecarboxylic acid [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-propan-2-yloxypropylamino)ethyl] 2-methylsulfanyl-3-phenylimidazole-4-carboxylate Traditional Name: 2-(methylthio)-3-phenyl-imidazole-4-carboxylic acid [2-(3-isopropoxypropylamino)-2-keto-ethyl] ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)COC(=O)C1=CN=C(N1C2=CC=CC=C2)SC

Isomeric SMILES

CC(C)OCCCNC(=O)COC(=O)C1=CN=C(N1C2=CC=CC=C2)SC

InChI

InChI=1S/C19H25N3O4S/c1-14(2)25-11-7-10-20-17(23)13-26-18(24)16-12-21-19(27-3)22(16)15-8-5-4-6-9-15/h4-6,8-9,12,14H,7,10-11,13H2,1-3H3,(H,20,23)